Update Kokkos library in LAMMPS to v3.6.0

This commit is contained in:
Stan Gerald Moore
2022-05-05 11:44:47 -06:00
parent bd4bbbddbe
commit b79c0bc7b4
380 changed files with 41928 additions and 8786 deletions

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/*
//@HEADER
// ************************************************************************
//
// Kokkos v. 3.0
// Copyright (2020) National Technology & Engineering
// Solutions of Sandia, LLC (NTESS).
//
// Under the terms of Contract DE-NA0003525 with NTESS,
// the U.S. Government retains certain rights in this software.
//
// Redistribution and use in source and binary forms, with or without
// modification, are permitted provided that the following conditions are
// met:
//
// 1. Redistributions of source code must retain the above copyright
// notice, this list of conditions and the following disclaimer.
//
// 2. Redistributions in binary form must reproduce the above copyright
// notice, this list of conditions and the following disclaimer in the
// documentation and/or other materials provided with the distribution.
//
// 3. Neither the name of the Corporation nor the names of the
// contributors may be used to endorse or promote products derived from
// this software without specific prior written permission.
//
// THIS SOFTWARE IS PROVIDED BY NTESS "AS IS" AND ANY
// EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
// IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR
// PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL NTESS OR THE
// CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL,
// EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO,
// PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR
// PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF
// LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING
// NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
// SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
//
// Questions? Contact Christian R. Trott (crtrott@sandia.gov)
//
// ************************************************************************
//@HEADER
*/
#include <TestStdAlgorithmsCommon.hpp>
#include <std_algorithms/Kokkos_BeginEnd.hpp>
#include <std_algorithms/Kokkos_ModifyingSequenceOperations.hpp>
#include <utility>
namespace Test {
namespace stdalgos {
namespace FindEnd {
namespace KE = Kokkos::Experimental;
template <class ValueType>
struct UnifDist;
template <>
struct UnifDist<int> {
using dist_type = std::uniform_int_distribution<int>;
std::mt19937 m_gen;
dist_type m_dist;
UnifDist() : m_dist(0, 20) { m_gen.seed(1034343); }
UnifDist(int a, int b) : m_dist(a, b) { m_gen.seed(234343); }
int operator()() { return m_dist(m_gen); }
};
template <class ViewType>
void fill_view(ViewType dest_view, const std::string& name) {
using value_type = typename ViewType::value_type;
using exe_space = typename ViewType::execution_space;
const std::size_t ext = dest_view.extent(0);
using aux_view_t = Kokkos::View<value_type*, exe_space>;
aux_view_t aux_view("aux_view", ext);
auto v_h = create_mirror_view(Kokkos::HostSpace(), aux_view);
if (name == "empty") {
// no op
}
else if (name == "one-element-a") {
v_h(0) = static_cast<value_type>(1);
}
else if (name == "one-element-b") {
v_h(0) = static_cast<value_type>(2);
}
else if (name == "two-elements-a") {
v_h(0) = static_cast<value_type>(1);
v_h(1) = static_cast<value_type>(2);
}
else if (name == "two-elements-b") {
v_h(0) = static_cast<value_type>(2);
v_h(1) = static_cast<value_type>(-1);
}
else if (name == "three-elements-a") {
v_h(0) = static_cast<value_type>(-1);
v_h(1) = static_cast<value_type>(2);
v_h(2) = static_cast<value_type>(2);
}
else if (name == "three-elements-b") {
v_h(0) = static_cast<value_type>(3);
v_h(1) = static_cast<value_type>(1);
v_h(2) = static_cast<value_type>(3);
}
else if (name == "four-elements-a") {
v_h(0) = static_cast<value_type>(-1);
v_h(1) = static_cast<value_type>(2);
v_h(2) = static_cast<value_type>(2);
v_h(3) = static_cast<value_type>(4);
}
else if (name == "four-elements-b") {
v_h(0) = static_cast<value_type>(1);
v_h(1) = static_cast<value_type>(1);
v_h(2) = static_cast<value_type>(1);
v_h(3) = static_cast<value_type>(1);
}
else if (name == "small-a") {
v_h(0) = static_cast<value_type>(0);
v_h(1) = static_cast<value_type>(4);
v_h(2) = static_cast<value_type>(1);
v_h(3) = static_cast<value_type>(2);
v_h(4) = static_cast<value_type>(-1);
v_h(5) = static_cast<value_type>(4);
v_h(6) = static_cast<value_type>(1);
v_h(7) = static_cast<value_type>(2);
v_h(8) = static_cast<value_type>(2);
v_h(9) = static_cast<value_type>(4);
v_h(10) = static_cast<value_type>(1);
}
else if (name == "small-b") {
v_h(0) = static_cast<value_type>(1);
v_h(1) = static_cast<value_type>(2);
v_h(2) = static_cast<value_type>(3);
v_h(3) = static_cast<value_type>(1);
v_h(4) = static_cast<value_type>(-1);
v_h(5) = static_cast<value_type>(-2);
v_h(6) = static_cast<value_type>(0);
v_h(7) = static_cast<value_type>(1);
v_h(8) = static_cast<value_type>(2);
v_h(9) = static_cast<value_type>(2);
v_h(10) = static_cast<value_type>(5);
v_h(11) = static_cast<value_type>(9);
v_h(12) = static_cast<value_type>(8);
}
else {
UnifDist<value_type> randObj;
for (std::size_t i = 0; i < ext; ++i) {
v_h(i) = randObj();
}
}
Kokkos::deep_copy(aux_view, v_h);
CopyFunctor<aux_view_t, ViewType> F1(aux_view, dest_view);
Kokkos::parallel_for("copy", dest_view.extent(0), F1);
}
template <class ViewType>
auto create_seq(ViewType data_view, std::size_t seq_extent) {
// we need to specify a sequence that we search for
// within the original view/range.
// to do this, rather than doing something purely random,
// we use the view with the data, and select a subsequence.
auto data_view_h = create_host_space_copy(data_view);
const auto data_view_extent = data_view.extent(0);
using value_type = typename ViewType::value_type;
using exe_space = typename ViewType::execution_space;
using seq_view_t = Kokkos::View<value_type*, exe_space>;
seq_view_t seq_view("seq_view", seq_extent);
auto seq_view_h = create_mirror_view(Kokkos::HostSpace(), seq_view);
// when the target sequence is of same size as view, just fill
// sequeunce with all values of the view
if (seq_extent == data_view_extent) {
for (std::size_t i = 0; i < seq_extent; ++i) {
seq_view_h(i) = data_view_h(i);
}
} else {
// if target sequence to fill is smaller, then we need to pick
// a starting point to copy data from to make the the sequence.
// we pick randomly between 0 and data_view_extent - seq_extent.
// and fill the sequeunce data with the values copied from data view.
using dist_type = std::uniform_int_distribution<int>;
std::random_device r;
// from this:
// https://stackoverflow.com/questions/34490599/c11-how-to-set-seed-using-random
std::seed_seq seed{r(), r(), r(), r(), r(), r()};
std::mt19937 gen(seed);
dist_type dist(0, data_view_extent - seq_extent);
const auto start = dist(gen);
// std::cout << "start= " << start << "\n";
for (std::size_t i = 0; i < seq_extent; ++i) {
seq_view_h(i) = data_view_h(start + i);
// std::cout << "i= " << i << " " << seq_view_h(i) << "\n";
}
}
Kokkos::deep_copy(seq_view, seq_view_h);
return seq_view;
}
// search is only avai from c++17, so I have to put it here
template <class ForwardIt1, class ForwardIt2, class BinaryPredicate>
ForwardIt1 my_std_search(ForwardIt1 first, ForwardIt1 last, ForwardIt2 s_first,
ForwardIt2 s_last, BinaryPredicate p) {
for (;; ++first) {
ForwardIt1 it = first;
for (ForwardIt2 s_it = s_first;; ++it, ++s_it) {
if (s_it == s_last) {
return first;
}
if (it == last) {
return last;
}
if (!p(*it, *s_it)) {
break;
}
}
}
}
// only avai from c++17, so I have to put it here
template <class ForwardIt1, class ForwardIt2, class BinaryPredicate>
ForwardIt1 my_std_find_end(ForwardIt1 first, ForwardIt1 last,
ForwardIt2 s_first, ForwardIt2 s_last,
BinaryPredicate p) {
if (s_first == s_last) {
return last;
}
ForwardIt1 result = last;
while (true) {
ForwardIt1 new_result = my_std_search(first, last, s_first, s_last, p);
if (new_result == last) {
break;
} else {
result = new_result;
first = result;
++first;
}
}
return result;
}
template <class ForwardIt1, class ForwardIt2>
ForwardIt1 my_std_find_end(ForwardIt1 first, ForwardIt1 last,
ForwardIt2 s_first, ForwardIt2 s_last) {
using value_type1 = typename ForwardIt1::value_type;
using value_type2 = typename ForwardIt2::value_type;
using pred_t = IsEqualFunctor<value_type1, value_type2>;
return my_std_find_end(first, last, s_first, s_last, pred_t());
}
std::string value_type_to_string(int) { return "int"; }
std::string value_type_to_string(double) { return "double"; }
template <class Tag, class ValueType>
void print_scenario_details(const std::string& name, std::size_t seq_ext) {
std::cout << "find_end: default predicate: " << name << ", "
<< "find_end_seq_ext = " << seq_ext << ", "
<< view_tag_to_string(Tag{}) << " "
<< value_type_to_string(ValueType()) << std::endl;
}
template <class Tag, class ValueType, class Predicate>
void print_scenario_details(const std::string& name, std::size_t seq_ext,
Predicate pred) {
(void)pred;
std::cout << "find_end: custom predicate: " << name << ", "
<< "find_end_seq_ext = " << seq_ext << ", "
<< view_tag_to_string(Tag{}) << " "
<< value_type_to_string(ValueType()) << std::endl;
}
template <class Tag, class ValueType, class InfoType, class... Args>
void run_single_scenario(const InfoType& scenario_info, std::size_t seq_ext,
Args... args) {
const auto name = std::get<0>(scenario_info);
const std::size_t view_ext = std::get<1>(scenario_info);
// print_scenario_details<Tag, ValueType>(name, seq_ext, args...);
auto view = create_view<ValueType>(Tag{}, view_ext, "find_end_test_view");
fill_view(view, name);
auto s_view = create_seq(view, seq_ext);
// run std
auto view_h = create_host_space_copy(view);
auto s_view_h = create_host_space_copy(s_view);
auto stdrit =
my_std_find_end(KE::cbegin(view_h), KE::cend(view_h),
KE::cbegin(s_view_h), KE::cend(s_view_h), args...);
{
auto myrit = KE::find_end(exespace(), KE::cbegin(view), KE::cend(view),
KE::cbegin(s_view), KE::cend(s_view), args...);
const auto mydiff = myrit - KE::cbegin(view);
const auto stddiff = stdrit - KE::cbegin(view_h);
// std::cout << "result : " << mydiff << " " << stddiff << std::endl;
EXPECT_TRUE(mydiff == stddiff);
}
{
auto myrit =
KE::find_end("label", exespace(), KE::cbegin(view), KE::cend(view),
KE::cbegin(s_view), KE::cend(s_view), args...);
const auto mydiff = myrit - KE::cbegin(view);
const auto stddiff = stdrit - KE::cbegin(view_h);
EXPECT_TRUE(mydiff == stddiff);
}
{
auto myrit = KE::find_end(exespace(), view, s_view, args...);
const auto mydiff = myrit - KE::begin(view);
const auto stddiff = stdrit - KE::cbegin(view_h);
EXPECT_TRUE(mydiff == stddiff);
}
{
auto myrit = KE::find_end("label", exespace(), view, s_view, args...);
const auto mydiff = myrit - KE::begin(view);
const auto stddiff = stdrit - KE::cbegin(view_h);
EXPECT_TRUE(mydiff == stddiff);
}
Kokkos::fence();
}
template <class Tag, class ValueType>
void run_all_scenarios() {
const std::map<std::string, std::size_t> scenarios = {{"empty", 0},
{"one-element-a", 1},
{"one-element-b", 1},
{"two-elements-a", 2},
{"two-elements-b", 2},
{"three-elements-a", 3},
{"three-elements-b", 3},
{"four-elements-a", 4},
{"four-elements-b", 4},
{"small-a", 11},
{"small-b", 13},
{"medium-a", 11103},
{"medium-b", 21103},
{"large-a", 101513},
{"large-b", 100111}};
const std::vector<std::size_t> seq_extents = {
0, 1, 2, 3, 4, 5, 8, 11, 15, 31, 113, 523, 1035, 11103};
// for each scenario we want to run "find_end"
// for a set of sequences of various extents
for (const auto& it : scenarios) {
for (const auto& it2 : seq_extents) {
// only run if view is larger or equal than sequence
if (it.second >= it2) {
run_single_scenario<Tag, ValueType>(it, it2);
using func_t = IsEqualFunctor<ValueType>;
run_single_scenario<Tag, ValueType>(it, it2, func_t());
}
}
}
}
TEST(std_algorithms_non_mod_seq_ops, find_end) {
run_all_scenarios<DynamicTag, int>();
run_all_scenarios<StridedThreeTag, int>();
}
} // namespace FindEnd
} // namespace stdalgos
} // namespace Test